ChemSpider 2D Image | (2S)-2-Amino-4-[(~13~C)methylsulfinyl]butanoic acid | C413CH11NO3S

(2S)-2-Amino-4-[(13C)methylsulfinyl]butanoic acid

  • Molecular FormulaC413CH11NO3S
  • Average mass166.203 Da
  • Monoisotopic mass166.049316 Da
  • ChemSpider ID107448309

  • defined stereocentres - 1 of 2 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2S)-2-Amino-4-[(13C)methylsulfinyl]butanoic acid [ACD/IUPAC Name]
(2S)-2-Amino-4-[(13C)methylsulfinyl]butansäure [German] [ACD/IUPAC Name]
Acide (2S)-2-amino-4-[(13C)méthylsulfinyl]butanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 2-amino-4-(methyl-13C-sulfinyl)-, (2S)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.570
Molar Refractivity: 39.1±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 15.5±0.5 10-24cm3
Surface Tension: 74.4±3.0 dyne/cm
Molar Volume: 119.3±3.0 cm3

Click to predict properties on the Chemicalize site


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